CID 6929

88-26-6

Structural Information

Molecular Formula
C15H24O2
SMILES
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CO
InChI
InChI=1S/C15H24O2/c1-14(2,3)11-7-10(9-16)8-12(13(11)17)15(4,5)6/h7-8,16-17H,9H2,1-6H3
InChIKey
HNURKXXMYARGAY-UHFFFAOYSA-N
Compound name
2,6-ditert-butyl-4-(hydroxymethyl)phenol
Related CIDs

2D Structure

compound 2d structure
6
Annotation Hits

9
References

7081
Patents

236.17763 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.18491 156.6
[M+Na]+ 259.16685 164.4
[M-H]- 235.17035 158.3
[M+NH4]+ 254.21145 174.4
[M+K]+ 275.14079 161.6
[M+H-H2O]+ 219.17489 152.4
[M+HCOO]- 281.17583 173.6
[M+CH3COO]- 295.19148 191.4
[M+Na-2H]- 257.15230 160.4
[M]+ 236.17708 158.0
[M]- 236.17818 158.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe